MolNFT v1 · #27913 · protein
Crystal structure analysis of deamino-oxytocin. conformational flexibility and receptor binding
1XY1 · Beta-mercaptopropionate-oxytocin: “Crystal structure analysis of deamino-oxytocin. conformational flexibility and receptor binding”. X-ray diffraction, 2 ligands (MPT, NH2). MolNFT v1 #27913 on GenesisL1: 3D structure, binding sites…
- PDB
- 1XY1
- Type
- protein
- Length
- 16 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Beta-mercaptopropionate-oxytocin
- Ligands
- MPT, NH2
Structure
x-ray diffraction · 1 distinct chain · 0% helix, 0% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B | Beta-mercaptopropionate-oxytocin | protein | 8 | 0% helix, 0% strand | — |
Ligands and binding sites
- MPT · Beta-mercaptopropionic acid · ligand · 2 copies · chains A, B
- NH2 · Amino group · ion · 2 copies · chains A, B
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Interfaces
1 interface between chains.
- A–B · 154 Ų buried · 0 hydrogen bonds · protein-protein
Modifications
Observed in the structure: 4 covalent (covalent ligand).
Compared structures
- 1XY1 · Crystal structure analysis of deamino-oxytocin. conformational flexibility and receptor… · the same entry in another collection · chain A against A, TM-score 1.00
Analyse
- Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
- Elsewhere: RCSB PDB 1XY1 · PDBe 1XY1
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